1,2-pentanediol profile

1,2-Pentanediol is a chiral diol with a five-carbon backbone. It can be synthesized through various methods, including the hydroformylation of 1,3-butadiene followed by hydrogenation. 1,2-Pentanediol has been investigated for its potential applications in various fields, such as the production of polymers, pharmaceuticals, and cosmetics. Its importance lies in its versatility as a building block for various chemical products. The chiral nature of 1,2-pentanediol makes it an attractive target for enantioselective synthesis and applications. Research on 1,2-pentanediol aims to explore its potential as a precursor for valuable chemicals and to develop efficient and sustainable methods for its production.'
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ID Source	ID
PubMed CID	93000
SCHEMBL ID	62155
MeSH ID	M0421330

Synonym
pentane-1,2-diol
brn 1719151
ai3-03317
einecs 226-285-3
nsc-513
5343-92-0
nsc513
1,2-pentanediol ,
1,2-pentanediol, 96%
FT-0690841
inchi=1/c5h12o2/c1-2-3-5(7)4-6/h5-7h,2-4h2,1h3
wcvrqhfdjllwfe-uhfffaoysa-
P1178
1,2-dihydroxypentane
AKOS009156977
A829586
50c1307pzg ,
ec 226-285-3
3-01-00-02191 (beilstein handbook reference)
unii-50c1307pzg
nsc 513
FT-0606477
pentylene glycol [inci]
pentylene glycol [who-dd]
(+/-)-1,2-pentanediol
SCHEMBL62155
mfcd00010736
SY032914
DTXSID10863522
Q3374899
CS-0017222
AS-40006
EN300-52018
(+/-)-pentane-1,2-diol; 1,2-dihydroxypentane; 1,2-pentylene glycol; diol pd; hydrolite 5; nsc 513

Excerpt	Reference	Relevance
" Because the negative oral toxicity data on shorter chain 1,2-glycols and genotoxicity data support the safety of the 1,2-glycols reviewed in this safety assessment, the Panel concluded that these ingredients are safe in the present practices of use and concentration described in this safety assessment."	( Safety assessment of 1,2-glycols as used in cosmetics. Andersen, FA; Belsito, DV; Bergfeld, WF; Hill, RA; Johnson, W; Klaassen, CD; Liebler, D; Marks, JG; Shank, RC; Slaga, TJ; Snyder, PW, )	0.13

Excerpt	Reference	Relevance
" The purpose of this study was the improvement of the topical bioavailability of the hydrophilic dipeptides L-carnosine and its related compound N-acetyl-L-carnosine."	( Dermal peptide delivery using enhancer molecules and colloidal carrier systems--part I: carnosine. Goebel, AS; Neubert, RH; Schmaus, G; Wohlrab, J, 2012)	0.38

Timeframe	Studies, This Drug (%)	All Drugs %
pre-1990	0 (0.00)	18.7374
1990's	0 (0.00)	18.2507
2000's	4 (40.00)	29.6817
2010's	2 (20.00)	24.3611
2020's	4 (40.00)	2.80
[information is prepared from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Publication Type	This drug (%)	All Drugs (%)
Trials	0 (0.00%)	5.53%
Reviews	1 (9.09%)	6.00%
Case Studies	3 (27.27%)	4.05%
Observational	0 (0.00%)	0.25%
Other	7 (63.64%)	84.16%
[information is prepared from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Substance	Relationship Strength	Studies	Classes	Roles
dimethyl sulfoxide Dimethyl Sulfoxide: A highly polar organic liquid, that is used widely as a chemical solvent. Because of its ability to penetrate biological membranes, it is used as a vehicle for topical application of pharmaceuticals. It is also used to protect tissue during CRYOPRESERVATION. Dimethyl sulfoxide shows a range of pharmacological activity including analgesia and anti-inflammation.. dimethyl sulfoxide : A 2-carbon sulfoxide in which the sulfur atom has two methyl substituents.	2.21	1	sulfoxide; volatile organic compound	alkylating agent; antidote; Escherichia coli metabolite; geroprotector; MRI contrast agent; non-narcotic analgesic; polar aprotic solvent; radical scavenger
propylene glycol Propylene Glycol: A clear, colorless, viscous organic solvent and diluent used in pharmaceutical preparations.. propane-1,2-diol : The simplest member of the class of propane-1,2-diols, consisting of propane in which a hydrogen at position 1 and a hydrogen at position 2 are substituted by hydroxy groups. A colourless, viscous, hygroscopic, low-melting (-59degreeC) and high-boiling (188degreeC) liquid with low toxicity, it is used as a solvent, emulsifying agent, and antifreeze.	7.5	2	glycol; propane-1,2-diols	allergen; human xenobiotic metabolite; mouse metabolite; protic solvent
urea pseudourea: clinical use; structure. isourea : A carboximidic acid that is the imidic acid tautomer of urea, H2NC(=NH)OH, and its hydrocarbyl derivatives.	7.01	1	isourea; monocarboxylic acid amide; one-carbon compound	Daphnia magna metabolite; Escherichia coli metabolite; fertilizer; flour treatment agent; human metabolite; mouse metabolite; Saccharomyces cerevisiae metabolite
3-nitrobenzeneboronic acid [no description available]	2.02	1
caffeine [no description available]	2.51	2	purine alkaloid; trimethylxanthine	adenosine A2A receptor antagonist; adenosine receptor antagonist; adjuvant; central nervous system stimulant; diuretic; EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor; EC 3.1.4.* (phosphoric diester hydrolase) inhibitor; environmental contaminant; food additive; fungal metabolite; geroprotector; human blood serum metabolite; mouse metabolite; mutagen; plant metabolite; psychotropic drug; ryanodine receptor agonist; xenobiotic
aspartic acid Aspartic Acid: One of the non-essential amino acids commonly occurring in the L-form. It is found in animals and plants, especially in sugar cane and sugar beets. It may be a neurotransmitter.. aspartic acid : An alpha-amino acid that consists of succinic acid bearing a single alpha-amino substituent. L-aspartic acid : The L-enantiomer of aspartic acid.	2.03	1	aspartate family amino acid; aspartic acid; L-alpha-amino acid; proteinogenic amino acid	Escherichia coli metabolite; mouse metabolite; neurotransmitter
galactose galactopyranose : The pyranose form of galactose.	2.02	1	D-galactose; galactopyranose	Escherichia coli metabolite; mouse metabolite
n-pentanol n-pentanol: RN given refers to parent cpd. pentan-1-ol : A short-chain primary fatty alcohol that is pentane in which a hydrogen of one of the methyl groups is substituted by a hydroxy group. It has been isolated from Melicope ptelefolia.	2.71	3	pentanol; short-chain primary fatty alcohol	human metabolite; plant metabolite
hexylene glycol hexylene glycol: RN given refers to parent cpd. 2-methylpentane-2,4-diol : A glycol in which the two hydroxy groups are at positions 2 and 4 of 2-methylpentane (isopentane).	2.03	1	glycol
2-methylpentane Hexanes: Six-carbon saturated hydrocarbon group of the methane series. Include isomers and derivatives. Various polyneuropathies are caused by hexane poisoning.	2.21	1	alkane
1,3-butylene glycol 1,3-butylene glycol: RN given refers to cpd without isomeric designation. butane-1,3-diol : A butanediol compound having two hydroxy groups in the 1- and 3-positions.	2.21	1	butanediol; glycol
pentane Pentanes: Five-carbon saturated hydrocarbon group of the methane series. Include isomers and derivatives.. pentane : A straight chain alkane consisting of 5 carbon atoms.	3.69	9	alkane; volatile organic compound	non-polar solvent; refrigerant
1,5-pentanediol [no description available]	2.6	1	primary alcohol
cyclopentane Cyclopentanes: A group of alicyclic hydrocarbons with the general formula R-C5H9.. cyclopentanes : Cyclopentane and its derivatives formed by substitution.	2.02	1	cycloalkane; cyclopentanes; volatile organic compound	non-polar solvent
thiazoles [no description available]	2.01	1	1,3-thiazoles; mancude organic heteromonocyclic parent; monocyclic heteroarene
1,2-octanediol [no description available]	2.21	1	octanediol
phenoxyethanol phenoxyethanol: structure. 2-phenoxyethanol : An aromatic ether that is phenol substituted on oxygen by a 2-hydroxyethyl group.	7.01	1	aromatic ether; glycol ether; primary alcohol	antiinfective agent; central nervous system depressant
imidazolidinyl urea imidazolidinyl urea: RN given refers to parent cpd	7.01	1	ureas	antimicrobial agent
2-methyl-4-isothiazolin-3-one 2-methyl-4-isothiazolin-3-one: RN given refers to parent cpd; structure. methylisothiazolinone : A 1,2-thazole that is 4-isothiazolin-3-one bearing a methyl group on the nitrogen atom. It is a powerful biocide and preservative and is the minor active ingredient in the commercial product Kathon(TM).	2.01	1	1,2-thiazoles	antifouling biocide; antifungal agent; antimicrobial agent
benzeneboronic acid [no description available]	2.02	1	boronic acids
1,2-hexanediol [no description available]	2.21	1
carnosine polaprezinc: stimulates bone growth	2.07	1	amino acid zwitterion; dipeptide	anticonvulsant; antineoplastic agent; antioxidant; Daphnia magna metabolite; geroprotector; human metabolite; mouse metabolite; neuroprotective agent
n-acetylcarnosine N-acetylcarnosine: RN given refers to (L)-isomer; structure given in first source. N-acetylcarnosine : A dipeptide that is the N-acetyl derivative of carnosine.	2.07	1	dipeptide	metabolite

Condition	Relationship Strength	Studies
Allergic Contact Dermatitis [description not available]	3.07	3
Dermatitis, Allergic Contact A contact dermatitis due to allergic sensitization to various substances. These substances subsequently produce inflammatory reactions in the skin of those who have acquired hypersensitivity to them as a result of prior exposure.	3.07	3
Facial Dermatoses Skin diseases involving the FACE.	2.72	2
Necrosis The death of cells in an organ or tissue due to disease, injury or failure of the blood supply.	7.01	1

1,2-pentanediol

Cross-References

Synonyms (34)

Research Excerpts

Toxicity

Bioavailability

Research

Studies (10)

Market Indicators

Research Demand Index: 43.94

Study Types